In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: (1S,2R)-2-(aminomethyl)-N-methyl-N-[(2-methyl-3-furyl)methyl]cyclopentanamine (1S,2R)-2-(aminomethyl)-N-methyl…
None
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.98 | 5.65 | -107.38 | 4 | 3 | 2 | 45 | 224.348 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 3.36 | -45.68 | 3 | 3 | 1 | 44 | 223.34 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 5.26 | -32.95 | 3 | 3 | 1 | 44 | 223.34 | 4 | ↓ |